Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hq5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 8.A N PRO 4.A O no hydrogen 3.038 N/A LEU 9.A N PRO 5.A O no hydrogen 2.794 N/A LEU 10.A N LEU 6.A O no hydrogen 2.826 N/A MET 11.A N ILE 7.A O no hydrogen 2.940 N/A SER 12.A N ASN 8.A O no hydrogen 3.156 N/A SER 12.A OG LEU 9.A O no hydrogen 2.631 N/A ILE 13.A N LEU 9.A O no hydrogen 3.101 N/A GLU 14.A N MET 11.A O no hydrogen 3.382 N/A ALA 20.A N ASP 97.A OD1 no hydrogen 2.842 N/A GLY 21.A N ASP 97.A OD2 no hydrogen 2.799 N/A HIS 22.A N ASP 97.A OD2 no hydrogen 3.272 N/A HIS 22.A ND1 SER 33.A OG no hydrogen 2.548 N/A ASN 24.A N HIS 22.A O no hydrogen 2.795 N/A ASN 24.A ND2 ASP 23.A O no hydrogen 2.911 N/A THR 26.A N SER 29.A OG no hydrogen 3.315 N/A SER 27.A OG TYR 110.A OH no hydrogen 3.249 N/A SER 29.A OG THR 26.A O no hydrogen 2.921 N/A LEU 30.A N THR 26.A O no hydrogen 3.008 N/A LEU 31.A N SER 27.A O no hydrogen 3.175 N/A THR 32.A N SER 28.A O no hydrogen 2.962 N/A THR 32.A OG1 SER 28.A O no hydrogen 2.737 N/A SER 33.A N SER 29.A O no hydrogen 2.971 N/A SER 33.A OG HIS 22.A ND1 no hydrogen 2.548 N/A SER 33.A OG SER 29.A O no hydrogen 3.222 N/A LEU 34.A N LEU 30.A O no hydrogen 2.751 N/A ASN 35.A N LEU 31.A O no hydrogen 2.717 N/A ASN 35.A ND2 GLU 218.A O.A no hydrogen 2.997 N/A ASN 35.A ND2 GLU 218.A O.B no hydrogen 2.939 N/A GLN 36.A N THR 32.A O no hydrogen 3.001 N/A LEU 37.A N SER 33.A O no hydrogen 3.042 N/A GLY 38.A N LEU 34.A O no hydrogen 2.845 N/A GLU 39.A N ASN 35.A O no hydrogen 3.001 N/A ARG 40.A N GLN 36.A O no hydrogen 3.110 N/A ARG 40.A NE GLN 36.A OE1 no hydrogen 2.956 N/A ARG 40.A NH1 TYR 19.A O no hydrogen 2.918 N/A GLN 41.A N LEU 37.A O no hydrogen 2.780 N/A LEU 42.A N GLY 38.A O no hydrogen 2.957 N/A LEU 43.A N GLU 39.A O no hydrogen 3.124 N/A SER 44.A N ARG 40.A O no hydrogen 3.051 N/A VAL 45.A N GLN 41.A O no hydrogen 2.879 N/A VAL 46.A N LEU 42.A O no hydrogen 3.067 N/A LYS 47.A N LEU 43.A O no hydrogen 3.103 N/A TRP 48.A N SER 44.A O no hydrogen 2.858 N/A SER 49.A N VAL 45.A O no hydrogen 2.906 N/A SER 49.A OG VAL 46.A O no hydrogen 2.865 N/A LYS 50.A N LYS 47.A O no hydrogen 3.255 N/A SER 51.A N TRP 48.A O no hydrogen 3.152 N/A LEU 52.A N SER 49.A O no hydrogen 3.365 N/A PHE 55.A N LEU 52.A O no hydrogen 3.095 N/A ASN 57.A N GLY 54.A O no hydrogen 3.385 N/A LEU 58.A N PHE 55.A O no hydrogen 3.269 N/A HIS 59.A N SER 152.A OG no hydrogen 3.000 N/A GLN 63.A N HIS 59.A O no hydrogen 3.029 N/A GLN 63.A NE2 ARG 56.A O no hydrogen 3.254 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.770 N/A ILE 64.A N ILE 60.A O no hydrogen 3.048 N/A THR 65.A N ASP 61.A O no hydrogen 3.048 N/A THR 65.A OG1 ASP 61.A O no hydrogen 2.698 N/A LEU 66.A N ASP 62.A O no hydrogen 2.865 N/A ILE 67.A N GLN 63.A O no hydrogen 3.052 N/A GLN 68.A N ILE 64.A O no hydrogen 2.988 N/A TYR 69.A N THR 65.A O no hydrogen 2.833 N/A SER 70.A N LEU 66.A O no hydrogen 3.091 N/A SER 70.A OG LEU 66.A O no hydrogen 2.626 N/A LEU 74.A N SER 70.A O no hydrogen 2.856 N/A MET 75.A N TRP 71.A O no hydrogen 3.155 N/A VAL 76.A N MET 72.A O no hydrogen 3.034 N/A PHE 77.A N SER 73.A O no hydrogen 2.993 N/A GLY 78.A N LEU 74.A O no hydrogen 2.867 N/A LEU 79.A N MET 75.A O no hydrogen 2.859 N/A GLY 80.A N VAL 76.A O no hydrogen 2.937 N/A TRP 81.A N PHE 77.A O no hydrogen 3.185 N/A ARG 82.A N GLY 78.A O no hydrogen 3.001 N/A ARG 82.A NE TYR 93.A O no hydrogen 3.111 N/A ARG 82.A NH2 PHE 94.A O no hydrogen 3.174 N/A SER 83.A N LEU 79.A O no hydrogen 2.974 N/A SER 83.A OG LEU 79.A O no hydrogen 2.846 N/A SER 83.A OG MET 91.A O no hydrogen 3.169 N/A TYR 84.A N GLY 80.A O no hydrogen 3.012 N/A TYR 84.A OH VAL 128.A O no hydrogen 3.094 N/A LYS 85.A N TRP 81.A O no hydrogen 2.737 N/A HIS 86.A N ARG 82.A O no hydrogen 2.802 N/A VAL 87.A N SER 83.A O no hydrogen 3.072 N/A GLY 89.A N SER 83.A O no hydrogen 2.874 N/A GLN 90.A N VAL 87.A O no hydrogen 3.008 N/A GLN 90.A NE2 SER 88.A O no hydrogen 2.716 N/A GLN 90.A NE2 GLN 121.A OE1.B no hydrogen 3.430 N/A LEU 92.A N LEU 100.A O no hydrogen 2.884 N/A TYR 93.A N SER 83.A OG no hydrogen 2.752 N/A ALA 95.A N LEU 98.A O no hydrogen 3.196 N/A LEU 98.A N ALA 95.A O no hydrogen 2.919 N/A LEU 100.A N LEU 92.A O no hydrogen 2.983 N/A LYS 105.A NZ ASP 25.A O no hydrogen 3.255 N/A TYR 110.A OH SER 27.A OG no hydrogen 3.249 N/A TYR 110.A OH ARG 104.A O no hydrogen 2.660 N/A LEU 112.A N SER 108.A O no hydrogen 3.221 N/A CYS 113.A N PHE 109.A O no hydrogen 3.269 N/A CYS 113.A SG PHE 109.A O no hydrogen 3.654 N/A LEU 114.A N TYR 110.A O no hydrogen 3.338 N/A THR 115.A N SER 111.A O no hydrogen 3.332 N/A THR 115.A OG1 SER 111.A O no hydrogen 3.309 N/A MET 116.A N LEU 112.A O no hydrogen 2.943 N/A TRP 117.A N CYS 113.A O no hydrogen 2.842 N/A TRP 117.A NE1 GLY 89.A O no hydrogen 2.841 N/A GLN 118.A N THR 115.A O no hydrogen 3.211 N/A GLN 118.A NE2 THR 115.A O no hydrogen 3.021 N/A ILE 119.A N MET 116.A O no hydrogen 3.392 N/A GLN 121.A N.A TRP 117.A O no hydrogen 3.395 N/A GLN 121.A N.B TRP 117.A O no hydrogen 3.415 N/A GLU 122.A N GLN 118.A O no hydrogen 2.964 N/A PHE 123.A N ILE 119.A O no hydrogen 2.914 N/A VAL 124.A N PRO 120.A O no hydrogen 2.981 N/A LYS 125.A N GLN 121.A O.A no hydrogen 2.889 N/A LYS 125.A N GLN 121.A O.B no hydrogen 2.880 N/A LYS 125.A NZ GLU 122.A OE1 no hydrogen 2.872 N/A LEU 126.A N GLU 122.A O no hydrogen 2.941 N/A VAL 128.A N PHE 123.A O no hydrogen 3.233 N/A SER 129.A N GLU 132.A OE2 no hydrogen 2.897 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.768 N/A GLU 132.A N SER 129.A OG no hydrogen 3.120 N/A PHE 133.A N SER 129.A O no hydrogen 3.034 N/A LEU 134.A N GLN 130.A O no hydrogen 3.043 N/A CYS 135.A SG GLU 131.A O no hydrogen 3.449 N/A MET 136.A N GLU 132.A O no hydrogen 2.915 N/A LYS 137.A N PHE 133.A O no hydrogen 2.862 N/A LYS 137.A NZ GLU 14.A OE1 no hydrogen 2.889 N/A VAL 138.A N LEU 134.A O no hydrogen 3.465 N/A LEU 139.A N CYS 135.A O no hydrogen 3.253 N/A LEU 140.A N MET 136.A O no hydrogen 2.954 N/A LEU 141.A N LYS 137.A O no hydrogen 3.124 N/A LEU 142.A N VAL 138.A O no hydrogen 3.054 N/A ASN 143.A N LEU 140.A O no hydrogen 3.261 N/A ILE 145.A N LYS 240.A O no hydrogen 2.987 N/A GLU 148.A N GLU 148.A OE2 no hydrogen 2.649 N/A GLY 149.A N PRO 146.A O no hydrogen 2.824 N/A LEU 150.A N GLN 153.A OE1 no hydrogen 3.044 N/A ARG 151.A N ASP 62.A OD1 no hydrogen 3.111 N/A ARG 151.A NE ASP 61.A OD2 no hydrogen 3.392 N/A ARG 151.A NH2 ASP 61.A OD2 no hydrogen 3.322 N/A SER 152.A N ASP 62.A OD2 no hydrogen 2.696 N/A SER 152.A OG GLN 155.A OE1 no hydrogen 3.358 N/A GLN 153.A NE2 GLU 157.A OE1 no hydrogen 3.189 N/A PHE 156.A N SER 152.A O no hydrogen 2.958 N/A GLU 157.A N GLN 153.A O no hydrogen 2.979 N/A GLU 158.A N THR 154.A O no hydrogen 3.098 N/A MET 159.A N GLN 155.A O no hydrogen 2.972 N/A ARG 160.A N PHE 156.A O no hydrogen 2.938 N/A ARG 160.A NH1 LEU 142.A O no hydrogen 3.095 N/A ARG 160.A NH1 ASN 143.A OD1 no hydrogen 3.389 N/A SER 161.A N GLU 157.A O no hydrogen 3.058 N/A SER 161.A OG GLU 157.A O no hydrogen 3.216 N/A SER 162.A N GLU 158.A O no hydrogen 2.973 N/A SER 162.A OG GLU 158.A O no hydrogen 3.056 N/A TYR 163.A N MET 159.A O no hydrogen 3.140 N/A TYR 163.A OH PRO 53.A O no hydrogen 3.016 N/A ILE 164.A N ARG 160.A O no hydrogen 2.914 N/A ARG 165.A N SER 161.A O no hydrogen 2.981 N/A GLU 166.A N SER 162.A O no hydrogen 2.988 N/A LEU 167.A N TYR 163.A O no hydrogen 2.919 N/A ILE 168.A N ILE 164.A O no hydrogen 3.228 N/A LYS 169.A N ARG 165.A O no hydrogen 3.081 N/A LYS 169.A NZ GLU 166.A OE2 no hydrogen 3.073 N/A ALA 170.A N GLU 166.A O no hydrogen 2.870 N/A ILE 171.A N LEU 167.A O no hydrogen 2.769 N/A GLY 172.A N ILE 168.A O no hydrogen 2.899 N/A LEU 173.A N ALA 170.A O no hydrogen 3.289 N/A ARG 174.A N ILE 171.A O no hydrogen 3.478 N/A ARG 174.A NH1 GLN 127.A O no hydrogen 2.973 N/A ARG 174.A NH2 GLN 127.A O no hydrogen 3.033 N/A SER 180.A N GLY 176.A O no hydrogen 2.925 N/A SER 180.A OG GLY 176.A O no hydrogen 2.816 N/A GLN 182.A N VAL 178.A O no hydrogen 2.913 N/A ARG 183.A N SER 179.A O no hydrogen 2.885 N/A ARG 183.A NE GLU 132.A OE1 no hydrogen 2.807 N/A ARG 183.A NH1 LEU 126.A O no hydrogen 3.092 N/A ARG 183.A NH2 LEU 126.A O no hydrogen 2.959 N/A ARG 183.A NH2 GLU 132.A OE2 no hydrogen 3.013 N/A PHE 184.A N SER 180.A O no hydrogen 3.064 N/A TYR 185.A N SER 181.A O no hydrogen 3.052 N/A GLN 186.A N GLN 182.A O no hydrogen 2.930 N/A LEU 187.A N ARG 183.A O no hydrogen 2.905 N/A THR 188.A N PHE 184.A O no hydrogen 3.004 N/A THR 188.A OG1 PHE 184.A O no hydrogen 2.539 N/A THR 188.A OG1 TYR 185.A O no hydrogen 3.213 N/A THR 188.A OG1 HIS 245.A NE2 no hydrogen 2.846 N/A LYS 189.A N TYR 185.A O no hydrogen 2.880 N/A LEU 190.A N GLN 186.A O no hydrogen 3.260 N/A LEU 191.A N LEU 187.A O no hydrogen 3.335 N/A ASP 192.A N THR 188.A O no hydrogen 3.102 N/A ASN 193.A N LYS 189.A O no hydrogen 2.972 N/A LEU 194.A N LEU 191.A O no hydrogen 3.128 N/A HIS 195.A N ASP 192.A O no hydrogen 3.191 N/A HIS 195.A NE2 LEU 242.A O no hydrogen 3.127 N/A LEU 197.A N ASN 193.A O no hydrogen 3.448 N/A VAL 198.A N LEU 194.A O no hydrogen 2.754 N/A LYS 199.A N HIS 195.A O no hydrogen 3.086 N/A LYS 199.A NZ LEU 235.A O no hydrogen 2.873 N/A LEU 201.A N LEU 197.A O no hydrogen 3.333 N/A HIS 202.A N VAL 198.A O no hydrogen 2.777 N/A LEU 203.A N LYS 199.A O no hydrogen 3.049 N/A TYR 204.A N GLN 200.A O no hydrogen 3.185 N/A CYS 205.A N LEU 201.A O no hydrogen 2.927 N/A LEU 206.A N HIS 202.A O no hydrogen 2.912 N/A ASN 207.A N LEU 203.A O no hydrogen 2.989 N/A THR 208.A N TYR 204.A O no hydrogen 2.945 N/A THR 208.A OG1 TYR 204.A O no hydrogen 2.806 N/A PHE 209.A N CYS 205.A O no hydrogen 2.932 N/A ILE 210.A N LEU 206.A O no hydrogen 2.969 N/A GLN 211.A N ASN 207.A O no hydrogen 3.223 N/A SER 212.A N PHE 209.A O no hydrogen 3.240 N/A SER 212.A OG PHE 209.A O no hydrogen 3.214 N/A LEU 215.A N GLN 211.A O no hydrogen 2.963 N/A SER 216.A N ARG 213.A O no hydrogen 3.177 N/A VAL 217.A N SER 212.A O no hydrogen 3.046 N/A GLU 218.A N.A THR 32.A OG1 no hydrogen 3.345 N/A GLU 218.A N.B THR 32.A OG1 no hydrogen 3.335 N/A MET 222.A N GLU 39.A OE1 no hydrogen 3.065 N/A MET 223.A N GLU 39.A OE2 no hydrogen 2.888 N/A SER 224.A N PRO 220.A O no hydrogen 3.089 N/A SER 224.A OG PHE 219.A O no hydrogen 3.170 N/A SER 224.A OG PRO 220.A O no hydrogen 2.785 N/A GLU 225.A N GLU 221.A O no hydrogen 3.299 N/A ILE 227.A N MET 223.A O no hydrogen 3.069 N/A ALA 228.A N SER 224.A O no hydrogen 2.638 N/A ALA 229.A N GLU 225.A O no hydrogen 2.875 N/A GLN 230.A N VAL 226.A O no hydrogen 2.994 N/A ILE 234.A N GLN 230.A O no hydrogen 2.969 N/A LEU 235.A N LEU 231.A O no hydrogen 2.868 N/A ALA 236.A N PRO 232.A O no hydrogen 3.064 N/A GLY 237.A N ILE 234.A O no hydrogen 2.992 N/A MET 238.A N LYS 233.A O no hydrogen 2.929 N/A LYS 240.A N ILE 145.A O no hydrogen 2.659 N/A LEU 242.A N ASN 143.A O no hydrogen 2.836 N/A PHE 244.A N ASP 192.A OD2 no hydrogen 2.925 N/A HIS 245.A N ASP 192.A OD1 no hydrogen 3.124 N/A HIS 245.A NE2 THR 188.A OG1 no hydrogen 2.846 N/A